0 mol 7 unq 0 iso 0 dist 8.19144 5.77391 7.31201 11.1673 9.55056 5.44992 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.19144 5.77391 7.31201 8.71528 7.57354 4.74523 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.84459 10.3415 7.31201 14.7203 9.55056 5.44992 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.84459 10.3415 7.31201 10.8725 7.57354 4.74523 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.10253 10.3363 8.82012 9.0552 9.25649 15.2834 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.10253 10.3363 8.82012 6.32148 9.36104 14.0729 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 9.10253 16.9524 9.16962 9.0552 9.25649 17.7956 numMergedOcc 0
7 mol 26 unq 3 iso 0 dist 9.10253 16.9524 9.16962 6.32148 9.36104 15.23 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 7.61402 9.22921 6.99408 10.5468 7.95778 6.18811 numMergedOcc 0
9 mol 45 unq 1 iso 0 dist 7.61402 6.64343 9.3403 10.5468 7.95778 6.67086 numMergedOcc 0
10 mol 75 unq 0 iso 0 dist 7.49283 8.72784 6.33365 8.87463 9.48876 5.90778 numMergedOcc 0
11 mol 75 unq 1 iso 0 dist 7.49283 9.14798 5.15851 8.87463 9.48876 9.12189 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 6.58062 11.1785 5.81965 12.0489 9.28578 5.7134 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 6.58062 10.9352 7.06013 12.0489 9.28578 4.24513 numMergedOcc 0
14 mol 92 unq 2 iso 0 dist 6.58062 10.8489 9.70512 12.0489 9.28578 10.7874 numMergedOcc 0
15 mol 105 unq 0 iso 0 dist 6.13301 5.40409 8.36733 9.77118 8.76002 6.32377 numMergedOcc 0
16 mol 107 unq 0 iso 0 dist 9.25873 5.13248 8.40312 12.9521 8.13921 8.71052 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 6.87582 7.12329 6.99777 5.15368 9.9928 7.3094 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 8.77794 5.19652 6.99777 11.9046 9.9928 7.3094 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 6.16039 5.26656 6.79146 7.14836 6.42785 7.55374 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 6.16039 5.26656 6.79146 11.923 6.82089 9.44878 numMergedOcc 0
21 mol 130 unq 2 iso 0 dist 6.16039 10.6181 7.66168 7.14836 6.42785 11.576 numMergedOcc 0
22 mol 130 unq 3 iso 0 dist 6.16039 10.6181 7.66168 11.923 6.82089 4.28797 numMergedOcc 0
23 mol 130 unq 4 iso 0 dist 6.16039 9.86628 6.89257 7.14836 6.42785 5.97111 numMergedOcc 0
24 mol 130 unq 5 iso 0 dist 6.16039 9.86628 6.89257 11.923 6.82089 6.97875 numMergedOcc 0
25 mol 156 unq 0 iso 0 dist 9.22228 5.22807 6.88137 12.0584 7.04913 7.7635 numMergedOcc 0
26 mol 173 unq 0 iso 0 dist 9.13913 13.5954 7.93331 10.8276 7.54706 6.65184 numMergedOcc 0
27 mol 173 unq 1 iso 0 dist 9.13913 9.29369 6.98095 10.8276 7.54706 4.68119 numMergedOcc 0
28 mol 173 unq 2 iso 0 dist 9.13913 15.713 8.31897 10.8276 7.54706 6.6407 numMergedOcc 0
29 mol 175 unq 0 iso 0 dist 9.15536 10.5343 9.31887 14.8807 7.01126 13.9336 numMergedOcc 0
30 mol 175 unq 1 iso 0 dist 9.15536 10.5343 9.31887 9.37871 6.58434 11.873 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 9.7281 7.07865 7.37327 15.7969 7.96291 9.92777 numMergedOcc 0
32 mol 184 unq 0 iso 0 dist 7.95111 7.25468 9.52936 6.30834 6.21206 8.41716 numMergedOcc 0
33 mol 184 unq 1 iso 0 dist 7.95111 8.82012 9.15417 6.30834 6.21206 5.72305 numMergedOcc 0
34 mol 188 unq 0 iso 0 dist 8.61217 5.86754 6.90541 7.60757 7.48284 5.48276 numMergedOcc 0
35 mol 188 unq 1 iso 0 dist 9.56587 8.38962 6.90541 13.4214 7.48284 5.48276 numMergedOcc 0
36 mol 205 unq 0 iso 0 dist 7.70781 10.6362 9.19704 10.142 9.83885 5.54129 numMergedOcc 0
37 mol 205 unq 1 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 numMergedOcc 0
38 mol 213 unq 0 iso 0 dist 9.347 7.02346 4.26212 5.37448 7.78247 5.90341 numMergedOcc 0
39 mol 213 unq 1 iso 0 dist 9.347 7.02346 4.26212 8.10535 7.37935 5.84474 numMergedOcc 0
40 mol 214 unq 0 iso 0 dist 5.77917 7.05305 7.46831 6.23657 5.10114 5.63388 numMergedOcc 0
41 mol 214 unq 1 iso 0 dist 5.77917 6.33863 8.60247 6.23657 5.10114 6.214 numMergedOcc 0
42 mol 239 unq 0 iso 0 dist 8.5166 9.78463 7.39747 5.71442 7.18771 5.66732 numMergedOcc 0
43 mol 294 unq 0 iso 0 dist 9.17225 5.57044 9.03492 6.60365 8.32473 5.25615 numMergedOcc 0
